SCHEMBL11746390

SCHEMBL11746390

COc1cc2oc(C(=O)O)c(C)c2cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.63
▸ ALDH1A1 P00352 5/20 0.63
▸ GPR35 Q9HC97 1/20 0.63
▸ EDNRA P25101 1/20 0.56
▸ MCL1 Q07820 3/20 0.54
▸ HPGD P15428 6/20 0.48
▸ CHRM4 P08173 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ ADRA2C P18825 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ HTR3A P46098 1/20 0.47
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ MAPT P10636 3/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ TP53 P04637 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ TUBB4A P04350 1/20 0.46
▸ TUBB P07437 1/20 0.46
▸ TUBA3C P0DPH7 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11745361 0.88 ALDH1A1 (0.57) KDM4EALDH1A1GPR35EDNRAMCL1
SCHEMBL11750096 0.88 ALDH1A1 (0.57) KDM4EALDH1A1GPR35EDNRAMCL1
SCHEMBL11739450 0.86 KDM4E (0.56) KDM4EALDH1A1GPR35EDNRAMCL1
SCHEMBL27589169 0.82 KDM4E (0.47) KDM4EALDH1A1GPR35EDNRAMCL1
SCHEMBL16697971 0.79 KMT2A (0.59) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL5599691 0.79 GPR35 (0.71) KDM4EALDH1A1GPR35MCL1HPGD
SCHEMBL4762078 0.78 KDM4E (1.00) KDM4EALDH1A1GPR35EDNRAMCL1
SCHEMBL4763073 0.78 KDM4E (0.78) KDM4EALDH1A1MCL1HPGDMEN1
SCHEMBL14703003 0.77 GPR35 (1.00) KDM4EALDH1A1GPR35MCL1HPGD
SCHEMBL11746198 0.77 ALDH1A1 (0.55) KDM4EALDH1A1EDNRAHPGDMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2017-06-29 — — US disclosed
US-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2017-06-29 — — US disclosed
US-9532983-B2 Benzofuran compounds, compositions, kits and/or methods thereof SAVANNAH STATE UNIVERSITY (US) 2017-01-03 — — US disclosed
US-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2015-05-14 — — US disclosed
US-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2015-05-14 — — US disclosed
US-4009994-A Process and product of optical brightening with quaternized benzofuranyl-benzimidazoles CIBA-GEIGY CORPORATION (US) 1977-03-01 — — US disclosed
US-3940417-A Quaternised benzofuranyl-benzimidazoles CIBA-GEIGY CORPORATION (US) 1976-02-24 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SIGMAR1, OPRM1, OPRL1 KDM4E 2254/4885ALDH1A1 300/4885GPR35 175/4885
US-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SIGMAR1, OPRM1, OPRL1 KDM4E 2254/4885ALDH1A1 300/4885GPR35 175/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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